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CAS 80500-27-2

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4-Methyl-3-nitrobenzeneboronic acid

Description:
4-Methyl-3-nitrobenzeneboronic acid is an organic compound characterized by the presence of a boronic acid functional group, a nitro group, and a methyl substituent on a benzene ring. Its molecular structure features a boron atom bonded to a hydroxyl group and an aryl group, which enhances its reactivity in various chemical reactions, particularly in Suzuki coupling reactions, making it valuable in organic synthesis and medicinal chemistry. The nitro group introduces electron-withdrawing characteristics, influencing the compound's reactivity and solubility. Typically, this compound is a solid at room temperature and may exhibit moderate solubility in polar solvents. Its applications extend to the development of pharmaceuticals and agrochemicals, where it serves as a key intermediate. Additionally, the presence of both the nitro and boronic acid groups allows for diverse functionalization, making it a versatile building block in the synthesis of more complex molecules. Safety data should be consulted for handling, as with many boronic acids, it may pose certain hazards.
Formula:C7H8BNO4
InChI:InChI=1/C7H8BNO4/c1-5-2-3-6(8(10)11)4-7(5)9(12)13/h2-4,10-11H,1H3
SMILES:Cc1ccc(cc1N(=O)=O)B(O)O
Synonyms:
  • 4-Methyl-3-nitrophenylboronic acid
  • 3-Nitro-p-tolylboronic acid
  • (4-Methyl-3-Nitrophenyl)Boronic Acid
  • 3-Nitropheny-4-methylphenylboronic acid
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